1-(3,4-dichlorophenyl)-3-(4-methylpiperazin-4-ium-1-yl)urea

Systemtic Name: 1-(3,4-dichlorophenyl)-3-(4-methylpiperazin-4-ium-1-yl)urea Openeye Name: 1-(3,4-dichlorophenyl)-3-(4-methylpiperazin-4-ium-1-yl)urea CAS Name: 1-(3,4-dichlorophenyl)-3-(4-methyl-1-piperazin-4-iumyl)urea IUPAC Name: 1-(3,4-dichlorophenyl)-3-(4-methylpiperazin-4-ium-1-yl)urea Traditional Name: 1-(3,4-dichlorophenyl)-3-(4-methylpiperazin-4-ium-1-yl)urea Formula: C12H17Cl2N4O+ MolecularWeight: 304.19558

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)NC(=O)NC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)NC(=O)NC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C12H16Cl2N4O/c1-17-4-6-18(7-5-17)16-12(19)15-9-2-3-10(13)11(14)8-9/h2-3,8H,4-7H2,1H3,(H2,15,16,19)/p+1